2(1H)-Pyrimidinone, 4-Amino-1-[4-Amino-6-O-(3-Amino-3-Deoxy-β-D-Glucopyranosyl)-4-Deoxy-D-Glycero-D-Galacto-β-D-Gluco-Undecopyranosyl]-
Properties
Property | Value |
---|---|
Formula | C21H37N5O14 |
IUPAC Name | 4-amino-1-[(2r,3r,4s,5s,6s)-5-amino-6-[(1r,2s,3s,4r,5r)-1-[(2s,3r,4s,5s,6r)-4-amino-3,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-2,3,4,5,6-pentahydroxy-hexyl]-3,4-dihydroxy-tetrahydropyran-2-yl]pyrimidin-2-one |
Molecular Mass | 583.544 g·mol−1 |
Heat of Formation | -2549.7 ± 16.7 kJ·mol−1 |
Dipole Moment | 9.06 ± 1.08 D |
Volume | 635.23 Å 3 |
Surface Area | 493.15 Å 2 |
HOMO Energy | -9.70 ± 0.55 eV |
LUMO Energy | 2.35 ± eV |
Point Group Symmetry | C1 |
InChIKey | VQQSDVBOXQHCHU-SKPOXZENSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |